SCHEMBL1386836

SCHEMBL1386836

O=C1C(=O)N(Cc2cc3cnccc3[nH]2)CCN1Cc1ccc(-c2ccc(Cl)s2)cc1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.62
F2 P00734 2/20 0.48
PRMT5 O14744 2/20 0.46
WDR77 Q9BQA1 2/20 0.46
CYP2A6 P11509 1/20 0.36
DAO P14920 1/20 0.34
NAMPT P43490 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1384301 0.89 F10 (0.66) F10F2PRMT5WDR77
SCHEMBL1385552 0.86 F10 (0.54) F10F2PRMT5WDR77NAMPT
SCHEMBL1385551 0.86 F10 (0.54) F10F2PRMT5WDR77NAMPT
SCHEMBL1386332 0.84 F10 (0.54) F10F2PRMT5WDR77NAMPT
SCHEMBL1384672 0.82 F10 (0.62) F10F2PRMT5WDR77CYP2A6
SCHEMBL1387140 0.81 F10 (0.63) F10F2PRMT5WDR77
SCHEMBL1385600 0.80 F10 (0.51) F10F2PRMT5WDR77CYP2A6
SCHEMBL1385601 0.80 F10 (0.51) F10F2PRMT5WDR77CYP2A6
SCHEMBL1386118 0.80 F10 (0.68) F10F2PRMT5WDR77DAO
SCHEMBL1386119 0.80 F10 (0.68) F10F2PRMT5WDR77DAO

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4829449-B2 2011-12-07 JP claimed
JP-2003508353-A 2003-03-04 JP claimed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP claimed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO claimed